(8R)-7-acetyl-8-methyl-N-(2-thiophen-2-ylethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide

C16H20N4O2S — CID 124798619

IUPAC(8R)-7-acetyl-8-methyl-N-(2-thiophen-2-ylethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide
SMILESCC(=O)N1CCn2cc(C(=O)NCCc3cccs3)nc2[C@H]1C
InChIInChI=1S/C16H20N4O2S/c1-11-15-18-14(10-19(15)7-8-20(11)12(2)21)16(22)17-6-5-13-4-3-9-23-13/h3-4,9-11H,5-8H2,1-2H3,(H,17,22)/t11-/m1/s1
InChIKeyFIQPIJMGPXZSLM-LLVKDONJSA-N
MW332.43 g/mol
LogP1.84
Rot. Bonds4

About (8R)-7-acetyl-8-methyl-N-(2-thiophen-2-ylethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide

(8R)-7-acetyl-8-methyl-N-(2-thiophen-2-ylethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide (PubChem CID 124798619) has the molecular formula C16H20N4O2S and a molecular weight of 332.43 g/mol. Its IUPAC name is (8R)-7-acetyl-8-methyl-N-(2-thiophen-2-ylethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide.

Molecular Properties

Compound Name(8R)-7-acetyl-8-methyl-N-(2-thiophen-2-ylethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide
PubChem CID124798619
Molecular FormulaC16H20N4O2S
Molecular Weight332.43 g/mol
Exact Mass332.13
IUPAC Name(8R)-7-acetyl-8-methyl-N-(2-thiophen-2-ylethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide
SMILESCC(=O)N1CCn2cc(C(=O)NCCc3cccs3)nc2[C@H]1C
InChIInChI=1S/C16H20N4O2S/c1-11-15-18-14(10-19(15)7-8-20(11)12(2)21)16(22)17-6-5-13-4-3-9-23-13/h3-4,9-11H,5-8H2,1-2H3,(H,17,22)/t11-/m1/s1
InChIKeyFIQPIJMGPXZSLM-LLVKDONJSA-N
XLogP1.84
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.43
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

8-methyl-7-methylsulfonyl-N-(2-thiophen-2-ylethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide
CID 131655886
7,8-dimethyl-N-(thiophen-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2,2,2-trifluoroacetic acid
CID 155839386
2-(7-cyclopentyl-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)-N-(2-thiophen-2-ylethyl)acetamide
CID 131663450
8-methyl-7-[(1-methylpyrazol-4-yl)methyl]-N-(thiophen-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide
CID 133137342
1-methyl-N-(2-thiophen-2-ylethyl)triazole-4-carboxamide
CID 45497207
5-methyl-N-(2-thiophen-2-ylethyl)-1,2-oxazole-3-carboxamide
CID 51072498
N-(2-thiophen-2-ylethyl)-1,3-thiazole-4-carboxamide
CID 62044830
2-[(2S)-2-[(2S)-1-acetylpyrrolidin-2-yl]pyrrolidin-1-yl]-N-(2-thiophen-2-ylethyl)acetamide
CID 95342533
6-(methylamino)-N-(2-thiophen-2-ylethyl)pyridine-2-carboxamide
CID 62240294
5-[(2R)-1-acetylpiperidin-2-yl]-1-methyl-N-(2-thiophen-2-ylethyl)pyrrole-2-carboxamide
CID 129336614
6-chloro-N-(2-thiophen-2-ylethyl)pyridine-2-carboxamide
CID 62233796
2,4-dimethyl-N-(2-thiophen-2-ylethyl)-1,3-oxazole-5-carboxamide
CID 110684821

Frequently Asked Questions

What is the IUPAC name of (8R)-7-acetyl-8-methyl-N-(2-thiophen-2-ylethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide?
The IUPAC name of (8R)-7-acetyl-8-methyl-N-(2-thiophen-2-ylethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide (CID 124798619) is (8R)-7-acetyl-8-methyl-N-(2-thiophen-2-ylethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide.
What is the SMILES notation for (8R)-7-acetyl-8-methyl-N-(2-thiophen-2-ylethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide?
The canonical SMILES for (8R)-7-acetyl-8-methyl-N-(2-thiophen-2-ylethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide is CC(=O)N1CCn2cc(C(=O)NCCc3cccs3)nc2[C@H]1C.
What is the InChIKey of (8R)-7-acetyl-8-methyl-N-(2-thiophen-2-ylethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide?
The InChIKey is FIQPIJMGPXZSLM-LLVKDONJSA-N. The full InChI is InChI=1S/C16H20N4O2S/c1-11-15-18-14(10-19(15)7-8-20(11)12(2)21)16(22)17-6-5-13-4-3-9-23-13/h3-4,9-11H,5-8H2,1-2H3,(H,17,22)/t11-/m1/s1.
What are the key properties of (8R)-7-acetyl-8-methyl-N-(2-thiophen-2-ylethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide?
(8R)-7-acetyl-8-methyl-N-(2-thiophen-2-ylethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide has a molecular weight of 332.43 g/mol, XLogP of 1.84, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (8R)-7-acetyl-8-methyl-N-(2-thiophen-2-ylethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide is sourced from PubChem (CID 124798619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).